Cas no 14323-17-2 (Iron,tris(1-phenyl-1,3-butanedionato-kO1,kO3)-)

Iron,tris(1-phenyl-1,3-butanedionato-kO1,kO3)- structure
14323-17-2 structure
Product Name:Iron,tris(1-phenyl-1,3-butanedionato-kO1,kO3)-
CAS No:14323-17-2
MF:C30H27FeO6
MW:539.37679028511
CID:160845
PubChem ID:5488997
Update Time:2025-04-19

Iron,tris(1-phenyl-1,3-butanedionato-kO1,kO3)- Chemical and Physical Properties

Names and Identifiers

    • Iron,tris(1-phenyl-1,3-butanedionato-kO1,kO3)-
    • FERRIC BENZOYLACETONATE
    • FERRIC PHENYLBUTANEDIONATE
    • Iron,tris(1-phenyl-1,3-butanedionato-O,O')
    • TRIS(1-PHENYL-1,3-BUTANEDIONATO)IRON(III)
    • TRIS(1-PHENYL-1,3-BUTANEDIONO)IRON
    • TRIS(1-PHENYL-1,3-BUTANEDIONO)IRON III
    • tris(1-phenylbutane-1,3-dionato-O,O')iron
    • IRON III BENZOYLACETONATE
    • tris(1-phenyl-1,3-butanedionato-o,o’)-iro
    • Iron, tris(1-phenyl-1,3-butanedionato-O,O')-
    • FERRICBENZOYLACETONATE,CA.11%FE
    • iron(3+);(Z)-3-oxo-1-phenylbut-1-en-1-olate
    • Iron, tris(1-phenyl-1,3-butanedionato-kappaO,kappaO')-
    • DTXSID401015329
    • 14323-17-2
    • Iron, tris(1-phenyl-1,3-butanedionato-.kappa.O,.kappa.O')-
    • Iron, tris(1-phenyl-1,3-butanedionato-kappaO1,kappaO3)-
    • EINECS 238-267-2
    • AKTNILSPEUKFSK-YNEVXYPXSA-K
    • MDL: MFCD00041938
    • Inchi: 1S/3C10H10O2.Fe/c3*1-8(11)7-10(12)9-5-3-2-4-6-9;/h3*2-7,12H,1H3;/q;;;+3/p-3/b3*10-7-;
    • InChI Key: AKTNILSPEUKFSK-YNEVXYPXSA-K
    • SMILES: [Fe+3].[O-]/C(=C\C(C)=O)/C1C=CC=CC=1.[O-]/C(=C\C(C)=O)/C1C=CC=CC=1.[O-]/C(=C\C(C)=O)/C1C=CC=CC=1

Computed Properties

  • Exact Mass: 569.12600
  • Monoisotopic Mass: 539.115699g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 37
  • Rotatable Bond Count: 6
  • Complexity: 188
  • Covalently-Bonded Unit Count: 4
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 3
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • XLogP3: Not available
  • Topological Polar Surface Area: 120

Experimental Properties

  • Color/Form: Not available
  • Melting Point: 216 °C
  • PSA: 88.13000
  • LogP: 6.26380
  • Solubility: Not available

Iron,tris(1-phenyl-1,3-butanedionato-kO1,kO3)- Security Information

  • Hazard Category Code: 36/37/38
  • Safety Instruction: S24/25
  • Risk Phrases:R36/37/38
  • TSCA:Yes

Iron,tris(1-phenyl-1,3-butanedionato-kO1,kO3)- Related Literature

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